5-[(E)-but-2-enoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Names

[ CAS No. ]:
144400-94-2

[ Name ]:
5-[(E)-but-2-enoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Chemical & Physical Properties

[ Density]:
1.133g/cm3

[ Boiling Point ]:
403.4ºC at 760mmHg

[ Molecular Formula ]:
C14H16N2O2

[ Molecular Weight ]:
244.28900

[ Flash Point ]:
197.8ºC

[ Exact Mass ]:
244.12100

[ PSA ]:
52.90000

[ LogP ]:
2.47650

[ Vapour Pressure ]:
1.02E-06mmHg at 25°C

[ Index of Refraction ]:
1.55

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DF2745500
CHEMICAL NAME :
2H-1,5-Benzodiazepin-2-one, 1,3,4,5-tetrahydro-4-methyl-5-(1-oxo-2-butenyl)-
CAS REGISTRY NUMBER :
144400-94-2
LAST UPDATED :
199403
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C14-H16-N2-O2
MOLECULAR WEIGHT :
244.32

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>2500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PJPPAA Polish Journal of Pharmacology and Pharmacy. (ARS Polona, POB 1001, 00-068 Warsaw 1, Poland) V.25- 1973- Volume(issue)/page/year: 43,495,1991
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1451 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PJPPAA Polish Journal of Pharmacology and Pharmacy. (ARS Polona, POB 1001, 00-068 Warsaw 1, Poland) V.25- 1973- Volume(issue)/page/year: 43,495,1991

Related Compounds

  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-Methyl-1,4,5,6-tetrahydropyrimidin-2-amine
  • Oxybis[(difluoromethoxy)difluoromethane]
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 16-(4-hydroxy-3-methoxyphenyl)-2,3,4,6,7,11,12,16-octahydro-1H,10H-[1,4]dioxepino[2',3':6,7]isoquino[2,1-a]quinolin-1-one
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]thieno[3,2-d]pyrimidin-3-yl]acetamide